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Molecule
Didecyldimethylammonium Chloride
CAS: 7173-51-5 · C22H48ClN
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 7173-51-5
- Molecular Formula
- C22H48ClN
- Molecular Mass
- 362.09 g/mol
Identifiers
CAS Registry Number
7173-51-5
SMILES
CCCCCCCCCC[N+](C)(C)CCCCCCCCCC.[Cl-]
InChI Key
RUPBZQFQVRMKDG-UHFFFAOYSA-M
InChI
InChI=1S/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1
Names and Synonyms
- Didecyldimethylammonium Chloride Synonym
- 1-Decanaminium, N-decyl-N,N-dimethyl-, chloride (1:1) Synonym
- Stenquat 1010 Synonym
- Asepas 3 Synonym
- Acticide DDQ Synonym
- Arquad 210-85E Synonym
- Nissan Cation 2DB500E Synonym
- K-Sanit BP 80 Synonym
- Bardac 2240 Synonym
- KleenGrow Synonym
- Cation DDC 50 Synonym
- Acticide DDQ 40 Synonym
- M 21080 Synonym
- Catiogen DDM-PG Synonym
- 2DB 500E Synonym
- Acticide Synonym
- Microbiocide N 750 Synonym
- N,N-Didecyl-N,N-dimethylammonium chloride Synonym
- Septapav KhS 70 Synonym
- New Des 50 Synonym
- Cation DDC 80 Synonym
- Nissan Cation 2DB800E Synonym
- Fentacare 1021-80 Synonym
- Bardac 2270ETM Synonym
- Bardac 50 Synonym
- Lipoquad 210-80E Synonym
- Bardac 2250R Synonym
- Bardac 2280R Synonym
- BTC 1010E Synonym
- Bardac 2280G Synonym
- Maquat 4450T Synonym
- Bardac 2250J Synonym
- Arquad 210-70HFP Synonym
- Uniquat 2240 Synonym
- Di-n-decyl-dimethylammonium chloride Synonym
- DDAC 80 Synonym
- Ammonium, didecyldimethyl-, chloride Synonym
- Didecyldimethylammonium chloride Synonym
- 1-Decanaminium, N-decyl-N,N-dimethyl-, chloride Synonym
- Dimethyldidecylammonium chloride Synonym
- Bardac 22 Synonym
- Quaternium 12 Synonym
- BTC 1010 Synonym
- Querton 210CL Synonym
- Dodigen 1881 Synonym
- Arquad 10 Synonym
- Tret-O-Lite XC 507 Synonym
- Bardac 2250 Synonym
- Bardac 2280 Synonym
- Nissan Cation 2DB Synonym
- Calgon H 130 Synonym
- Astop Synonym
- Bio-Dac Synonym
- Arquad 210-50 Synonym
- Bardac 2270E Synonym
- H 130 Synonym
- H 130 (molluscicide) Synonym
- DDAC Synonym
- DDC 80 Synonym
- Timbercote 2000 Synonym
- Slaoff 91 Synonym
- Britewood Q Synonym
- BTC 99 Synonym
- Didecyldimethylammounium chloride Synonym
- Maquat 4480E Synonym
- Quartamin D 10E Synonym
- Quartamin D 10P Synonym
- D 10P Synonym
- Cation DDC Synonym
- BTC 2250 Synonym
- Britewood XL Synonym
- Catiogen DDM Synonym
- Arquad 210-50E Synonym
- AQ 210 Synonym
- Microbiocide B 74 Synonym
- Arquad 210 Synonym
- Arquad 210-80E Synonym
- Kamin RM 2D50A Synonym
- Macrotrol MT 200 Synonym
- Sporekill Synonym
- Arquad 210-80 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 362.09 g/mol | CAS Common Chemistry |
| 362.0860000000001 g/mol | RDKit | |
| 362.086 g/mol | RDKit | |
| 362.083 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Didecyldimethylammonium_chloride | CAS Common Chemistry |
| Canonical SMILES | [Cl-].CCCCCCCCCC[N+](C)(C)CCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C22H48N.ClH/c1-5-7-9-11-13-15-17-19-21-23(3,4)22-20-18-16-14-12-10-8-6-2;/h5-22H2,1-4H3;1H/q+1;/p-1 | CAS Common Chemistry |
| InChI Key | InChIKey=RUPBZQFQVRMKDG-UHFFFAOYSA-M | CAS Common Chemistry |
| Melting Point | 88 °C | CAS Common Chemistry |
| Name | Didecyldimethylammonium chloride | CAS Common Chemistry |
| Heavy Atom Count | 24 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 18 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 4.348200000000004 | RDKit |
| 4.3482 | RDKit | |
| Molar Refractivity | 107.06240000000011 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 361.347528216 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 362.09 g/mol. Edit any field — others recompute live.
